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Compound FL0200

CAT: 0931-FL0200-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-FL0200-02Size:10 mg
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CAS Number
1114822-42-2
Bioactivity
Compound FL0200, with CAS No. 1114822-42-2, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0200 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
Smiles
NC1CN(Cc2ccccc2Cl)C(=O)C1
Molecular Formula
C11H13ClN2O
Molecular Weight
224.69
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

4-Amino-1-[(2-chlorophenyl)methyl]pyrrolidin-2-one
CAS Number1114822-42-2
PubChem CID20110076
IUPAC Name4-amino-1-[(2-chlorophenyl)methyl]pyrrolidin-2-one
Molecular FormulaC11H13ClN2O
Molecular Weight224.68
XLogP0.7
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count15
Formal Charge0
Complexity247
SMILES
C1C(CN(C1=O)CC2=CC=CC=C2Cl)N
InChI
InChI=1S/C11H13ClN2O/c12-10-4-2-1-3-8(10)6-14-7-9(13)5-11(14)15/h1-4,9H,5-7,13H2
InChIKey
UHISTAFNTIFXHV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Amino-1-[(2-chlorophenyl)methyl]pyrrolidin-2-one
CAS: 1114822-42-2
CID: 20110076
Formula: C11H13ClN2O
MW: 224.68
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.68
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass224.0716407
Monoisotopic Mass224.0716407
Topological Polar Surface Area46.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity247
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
FL0280-01Compound FL0280
FL0290-01Compound FL0290
FL0230-01Compound FL0230
FL0203-01Compound FL0203
FL0100-01Compound FL0100
FL0210-01Compound FL0210
FL0201-01Compound FL0201
FL0202-01Compound FL0202
FL0208-01Compound FL0208
FL0240-01Compound FL0240

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